3-(1H-pyrazol-5-ylsulfanyl)chromen-2-one

Systemtic Name: 3-(1H-pyrazol-5-ylsulfanyl)chromen-2-one Openeye Name: 3-(1H-pyrazol-5-ylsulfanyl)chromen-2-one CAS Name: 3-(1H-pyrazol-5-ylthio)-1-benzopyran-2-one IUPAC Name: 3-(1H-pyrazol-5-ylsulfanyl)chromen-2-one Traditional Name: 3-(1H-pyrazol-5-ylthio)coumarin Formula: C12H8N2O2S MolecularWeight: 244.26912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)SC3=CC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)SC3=CC=NN3

InChI

InChI=1S/C12H8N2O2S/c15-12-10(17-11-5-6-13-14-11)7-8-3-1-2-4-9(8)16-12/h1-7H,(H,13,14)